(2R)-2-[(5-methyloxolan-2-yl)methylamino]propan-1-ol

C9H19NO2 — CID 114985738

IUPAC(2R)-2-[(5-methyloxolan-2-yl)methylamino]propan-1-ol
SMILESCC1CCC(CN[C@H](C)CO)O1
InChIInChI=1S/C9H19NO2/c1-7(6-11)10-5-9-4-3-8(2)12-9/h7-11H,3-6H2,1-2H3/t7-,8?,9?/m1/s1
InChIKeySKEMPORZPCALOC-AFPNSQJFSA-N
MW173.26 g/mol
LogP0.52
Rot. Bonds4

About (2R)-2-[(5-methyloxolan-2-yl)methylamino]propan-1-ol

(2R)-2-[(5-methyloxolan-2-yl)methylamino]propan-1-ol (PubChem CID 114985738) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is (2R)-2-[(5-methyloxolan-2-yl)methylamino]propan-1-ol.

Molecular Properties

Compound Name(2R)-2-[(5-methyloxolan-2-yl)methylamino]propan-1-ol
PubChem CID114985738
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name(2R)-2-[(5-methyloxolan-2-yl)methylamino]propan-1-ol
SMILESCC1CCC(CN[C@H](C)CO)O1
InChIInChI=1S/C9H19NO2/c1-7(6-11)10-5-9-4-3-8(2)12-9/h7-11H,3-6H2,1-2H3/t7-,8?,9?/m1/s1
InChIKeySKEMPORZPCALOC-AFPNSQJFSA-N
XLogP0.52
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(5-methyloxolan-2-yl)methylamino]propane-1,3-diol
CID 82835778
1-methoxy-N-[(5-methyloxolan-2-yl)methyl]propan-2-amine
CID 82833761
N-[(5-methyloxolan-2-yl)methyl]-1-morpholin-4-ylpropan-2-amine
CID 82834990
3-[(5-methyloxolan-2-yl)methylamino]propane-1,2-diol
CID 82835676
N-[(5-methyloxolan-2-yl)methyl]-1-(5-methylthiophen-2-yl)propan-2-amine
CID 82835174
2-(cyclopropylmethylamino)propan-1-ol
CID 43560365
ethyl (2R,3S)-2-methyl-3-[[(2S,5S)-5-methyloxolan-2-yl]methylamino]butanoate
CID 124872586
1-(4-tert-butylphenyl)-N-[(5-methyloxolan-2-yl)methyl]ethanamine
CID 82834989
2-(3,4-dihydro-2H-pyran-2-ylmethylamino)propan-1-ol
CID 62066153
3-methyl-N-[(5-methyloxolan-2-yl)methyl]-2-propan-2-ylbutan-1-amine
CID 102904444
(1R)-1-(4-bromophenyl)-N-[(5-methyloxolan-2-yl)methyl]ethanamine
CID 82836687
(1S)-1-(furan-2-yl)-N-[(5-methyloxolan-2-yl)methyl]ethanamine
CID 82836690

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(5-methyloxolan-2-yl)methylamino]propan-1-ol?
The IUPAC name of (2R)-2-[(5-methyloxolan-2-yl)methylamino]propan-1-ol (CID 114985738) is (2R)-2-[(5-methyloxolan-2-yl)methylamino]propan-1-ol.
What is the SMILES notation for (2R)-2-[(5-methyloxolan-2-yl)methylamino]propan-1-ol?
The canonical SMILES for (2R)-2-[(5-methyloxolan-2-yl)methylamino]propan-1-ol is CC1CCC(CN[C@H](C)CO)O1.
What is the InChIKey of (2R)-2-[(5-methyloxolan-2-yl)methylamino]propan-1-ol?
The InChIKey is SKEMPORZPCALOC-AFPNSQJFSA-N. The full InChI is InChI=1S/C9H19NO2/c1-7(6-11)10-5-9-4-3-8(2)12-9/h7-11H,3-6H2,1-2H3/t7-,8?,9?/m1/s1.
What are the key properties of (2R)-2-[(5-methyloxolan-2-yl)methylamino]propan-1-ol?
(2R)-2-[(5-methyloxolan-2-yl)methylamino]propan-1-ol has a molecular weight of 173.26 g/mol, XLogP of 0.52, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(5-methyloxolan-2-yl)methylamino]propan-1-ol is sourced from PubChem (CID 114985738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).